- InChI
- InChI=1S/C26H45NO/c1-4-7-10-11-12-13-14-15-16-23-27(22-9-6-3)26(28)25-20-18-24(19-21-25)17-8-5-2/h18-21H,4-17,22-23H2,1-3H3
- InChI Key
- JQMOBGVRNCNKTG-UHFFFAOYSA-N
- Formula
- C26H45NO
- SMILES
-
CCCCCCCCCCCN(CCCC)C(=O)c1ccc(C
CCC)cc1 - Molecular Weight1
- 387.64
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 252.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -399.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 61.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.20 | kJ/mol | Joback Calculated Property |
| log10WS | -8.70 | Crippen Calculated Property | |
| logPoct/wat | 7.802 | Crippen Calculated Property | |
| McVol | 364.990 | ml/mol | McGowan Calculated Property |
| Pc | 898.02 | kPa | Joback Calculated Property |
| Inp | [2000.00; 2000.00] |
|
|
| Inp | 2000.00 | NIST | |
| Inp | 2000.00 | NIST | |
| Tboil | 892.25 | K | Joback Calculated Property |
| Tc | 1092.98 | K | Joback Calculated Property |
| Tfus | 504.12 | K | Joback Calculated Property |
| Vc | 1.407 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1204.80; 1310.33] | J/mol×K | [892.25; 1092.98] |
|
| Cp,gas | 1204.80 | J/mol×K | 892.25 | Joback Calculated Property |
| Cp,gas | 1225.16 | J/mol×K | 925.71 | Joback Calculated Property |
| Cp,gas | 1244.32 | J/mol×K | 959.16 | Joback Calculated Property |
| Cp,gas | 1262.34 | J/mol×K | 992.62 | Joback Calculated Property |
| Cp,gas | 1279.30 | J/mol×K | 1026.07 | Joback Calculated Property |
| Cp,gas | 1295.28 | J/mol×K | 1059.53 | Joback Calculated Property |
| Cp,gas | 1310.33 | J/mol×K | 1092.98 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 4-butyl-N-butyl-N-undecyl-.
Sources
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